ethyl 3-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 5-phenyl-3-[[2-[3-(p-tolylsulfonyl)propanoyloxy]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 5-phenyl-3-[[2-(3-tosylpropanoyloxy)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C25H25NO7S2 MolecularWeight: 515.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H25NO7S2/c1-3-32-25(29)24-20(15-21(34-24)18-7-5-4-6-8-18)26-22(27)16-33-23(28)13-14-35(30,31)19-11-9-17(2)10-12-19/h4-12,15H,3,13-14,16H2,1-2H3,(H,26,27)